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About This Item
Empirical Formula (Hill Notation):
C10H10O2
CAS Number:
Molecular Weight:
162.19
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
form:
solid
assay:
99%
Recommended Products
assay
99%
form
solid
bp
306 °C (lit.)
mp
36-37 °C (lit.)
density
1.155 g/mL at 25 °C (lit.)
SMILES string
O=C1CCC(O1)c2ccccc2
InChI
1S/C10H10O2/c11-10-7-6-9(12-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChI key
AEUULUMEYIPECD-UHFFFAOYSA-N
Gene Information
human ... CYP1A2(1544)
Storage Class
11 - Combustible Solids
wgk_germany
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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R O Juvonen et al.
Xenobiotica; the fate of foreign compounds in biological systems, 30(1), 81-92 (2000-02-05)
1. The structural requirements for a compound to be a potent inhibitor for mouse CYP2A5 and human CYP2A6 enzymes catalysing coumarin 7-hydroxylase activity have been studied. 2. The IC50 of 28 compounds for the pyrazole-treated male DBA/2 mouse and human
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